SpectraBase Spectrum ID |
IldBATdZmSZ |
Name |
1-Methoxy-8-methyl-12-oxatricyclo[6.3.1.0(3,7)]dodecane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
210.161979946 u |
Formula |
C13H22O2 |
InChI |
InChI=1S/C13H22O2/c1-12-7-4-8-13(14-2,15-12)9-10-5-3-6-11(10)12/h10-11H,3-9H2,1-2H3 |
InChIKey |
IMQRETYKPZGETQ-UHFFFAOYSA-N |
Molecular Weight |
210.317 g/mol |
SMILES |
C12(OC(OC)(CCC2)CC2C1CCC2)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916091 |